Vitas-M small molecule compound
2-{[4-benzyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Catalog ID
STL186066
SMILES O=C(Nc1cccc2c1cccc2)CSc1nnc(n1Cc1ccccc1)COc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H24N4O2S MW 480.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O2S/c33-27(29-25-17-9-13-22-12-7-8-16-24(22)25)20-35-28-31-30-26(19-34-23-14-5-2-6-15-23)32(28)18-21-10-3-1-4-11-21/h1-17H,18-20H2,(H,29,33)InChIKey
UFFWNRSJNNWIEK-UHFFFAOYSA-NSynonyms
2((4benzyl5(phenoxymethyl)124triazol3yl)sulfanyl)Nnaphthalen1ylacetamide
2((4benzyl5(phenoxymethyl)4H124triazol3yl)sulfanyl)N(naphthalen1yl)acetamide
C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=CC=CC4=CC=CC=C43)COC5=CC=CC=C5
InChI=1SC28H24N4O2Sc3327(2925179132212781624(22)25)203528313026(193423145261523)32(28)1821103141121h117H1820H2(H2933)
MFCD03051423
ZINC000000916198
ZINC00916198
ZINC916198
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